ethyl 4-(4-chlorophenyl)-5-methyl-2-(4-phenoxybutanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-(4-phenoxybutanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-(4-phenoxybutanoylamino)thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-5-methyl-2-[(1-oxo-4-phenoxybutyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-5-methyl-2-(4-phenoxybutanoylamino)thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-5-methyl-2-(4-phenoxybutanoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C24H24ClNO4S MolecularWeight: 457.96966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)Cl)C)NC(=O)CCCOC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)Cl)C)NC(=O)CCCOC3=CC=CC=C3

InChI

InChI=1S/C24H24ClNO4S/c1-3-29-24(28)22-21(17-11-13-18(25)14-12-17)16(2)31-23(22)26-20(27)10-7-15-30-19-8-5-4-6-9-19/h4-6,8-9,11-14H,3,7,10,15H2,1-2H3,(H,26,27)